| CAS Number | 954235-98-4 |
| Catalog Number | AG0060AL(AGN-PC-0W51GV) |
| Chemical Name | 1-Bromo-2-(difluoromethoxy)-3-fluorobenzene |
| IUPAC Name | 1-bromo-2-(difluoromethoxy)-3-fluorobenzene |
| InChI | InChI=1S/C7H4BrF3O/c8-4-2-1-3-5(9)6(4)12-7(10)11/h1-3,7H |
| InChI Key | KUCGCFDIABRYPJ-UHFFFAOYSA-N |
| MDL Number | MFCD11036073 |
| Molecular Formula | C7H4BrF3O |
| Molecular Weight | 241.0053 |
| SMILES | C1(=C(C=CC=C1F)Br)OC(F)F |
| Synonyms | 954235-98-4,
1-BROMO-2-DIFLUOROMETHOXY-3-FLUORO-BENZENE,
1-bromo-2-(difluoromethoxy)-3-fluorobenzene,
CTK5H7736,
DTXSID00669671,
4304AF,
MFCD11036073,
ZINC39325879,
AKOS015969258,
3-Bromo-2-(difluoromethoxy)fluorobenzene,
AS-48122,
1-Bromo-2-difluoromethoxy-3-fluorobenzene,
1-Bromo-2-(difluoromethoxy)-3-fluoro-benzene,
C7H4BrF3O,
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| Complexity | 145 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 239.94g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 241.007g/mol |
| Monoisotopic Mass | 239.94g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 9.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.6 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number